2-[(3-chloroanilino)methyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Chemical Structure Depiction of
2-[(3-chloroanilino)methyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
2-[(3-chloroanilino)methyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione
Compound characteristics
| Compound ID: | 1885-0362 |
| Compound Name: | 2-[(3-chloroanilino)methyl]-3a,4,7,7a-tetrahydro-1H-isoindole-1,3(2H)-dione |
| Molecular Weight: | 290.75 |
| Molecular Formula: | C15 H15 Cl N2 O2 |
| Smiles: | C1C=CCC2C1C(N(CNc1cccc(c1)[Cl])C2=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.0606 |
| logD: | 3.0606 |
| logSw: | -3.5035 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.843 |
| InChI Key: | URNHLFLHYODPLS-UHFFFAOYSA-N |